4-[3-(Trifluoromethyl)-2-Pyridinyl]-N-[5-(Trifluoromethyl)-2-Pyridinyl]-1-Piperazinecarboxamide

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Formula C17H15F6N5O
IUPAC Name 4-[3-(trifluoromethyl)-2-pyridyl]-n-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide
Molecular Mass 419.324 g·mol−1
Heat of Formation -1181.1 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 430.4 Å 3
Surface Area 372.81 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[3-(trifluoromethyl)-2-pyridyl]-n-[5-(trifluoromethyl)-2-pyridyl]-1-piperazinecarboxamide
  • 4-[3-(trifluoromethyl)-2-pyridyl]-n-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide
  • 4-[3-(trifluoromethyl)pyridin-2-yl]-n-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide
InChIKey JFRYYGVYCWYIDQ-UHFFFAOYSA-N
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